기본 정보
- CAS
83863-74-5- 표준 SMILES
Cn1ccc(C(=O)O)c1CC(=O)O- InChIKey
HCEANTQTOYOMSH-UHFFFAOYSA-N- 분자식
- C8H9NO4
- 평균 분자량
- 183.16 g/mol
- 단동위원소 질량
- 183.05315777
이름 및 식별자
- 우선 이름
- 3-Carboxy-1-methyl-1H-pyrrole-2-acetic acid
- IUPAC
- 2-(carboxymethyl)-1-methylpyrrole-3-carboxylic acid
- 현지명
- 2-카르복시메틸-1-메틸피롤-3-카르복실산
- 영어명
- 2-Carboxymethyl-1-methylpyrrole-3-carboxylic acid
- 분자식
- C8H9NO4
- 분자량
- 183.16
이름 및 동의어
83863-74-53-Carboxy-1-methyl-1H-pyrrole-2-acetic acidEINECS 281-140-1DTXSID00232763RefChem:93334DTXCID30155254281-140-12-(Carboxymethyl)-1-methyl-1H-pyrrole-3-carboxylic acid2-Carboxymethyl-1-methylpyrrole-3-carboxylic acidMFCD000449042-(carboxymethyl)-1-methylpyrrole-3-carboxylic acid2-(carboxymethyl)-1-methyl-pyrrole-3-carboxylic acid
이름 더 보기
2-카르복시메틸-1-메틸피롤-3-카르복실산2-CarboxyMethyl-1-Methylp...(3-Carboxy-1-methyl-1H-pyrrol-2-yl)acetic acid2-(carboxymethyl)-1-methyl-3-pyrrolecarboxylic acid
SCHEMBL3988622AKOS022705313PS-3409CS-00522421H-Pyrrole-2-acetic acid, 3-carboxy-1-methyl-54H7S98VJKPB24561BL002870
데이터베이스 식별자
- CAS
83863-74-5- PubChem CID
- 3019432
- DTXSID
DTXSID00232763- UNII
- 54H7S98VJK
- EC Number
- 281-140-1
- Nikkaji
- J326.949C
물성
구조 계산 물성
- XLogP
- -0.3
- 극성 표면적
- 79.5 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 228
물리화학적 성질
- 밀도
- 1.38 · 1.38
- 저장 조건
- 0 · Store at 0-8 °C
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.
Warning
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (50%)
안전 데이터
- HS 번호
- 2933998090
화학 및 산업
공급사21 곳
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Aladdin Scientific[email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
学研惠（武汉）科技有限公司15727060112 · [email protected]
南京斯贝源医药科技有限公司+86-25-68710855, +86-25-68710897 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
北京六合宁远医药科技股份有限公司010-60400365-8001 15910885229 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
范德(北京)生物科技有限责任公司
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